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• Synonyms (0)
• Vendors (0)
• Annotations (1)
• Representations (1)
• Notes (0)
• Targets (0)
• Clustered (0)
• Reactome (0)
• Rings (0)
• Analogs (3)

ZINC17141607

• 17141607

Physical Representations

Activity (Go SEA)

• 34218306
  

  Analogs

  45366076

  

  2040426

  

  Popular Name: 3S,7,11-Trimethyl-6,10-dodecadienoic acid 3S,7,11-Trimethyl-6,10-dodecadie…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Collaborative Drug Discovery

    • 1014573

  • Lipidomics

    • LMFA01030790

  • PubChem

    • 53870868
    • 10105638
    • 44256497

  And 2 More

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  Physical Representations

  Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	4.88	11.04	-43.46	0	2	-1	40	237.363	8	↓ MOL2 SDF SMILES Flexibase
  Lo Low (pH 4.5-6)	4.88	9.05	-5.04	1	2	0	37	238.371	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC34218306
• 39310150
  

  Analogs

  45366076

  

  2040426

  

  Popular Name: (3S,6E,10E)-3,7,11,15-tetramethylhexadeca-6,10,14-trienoic (3S,6E,10E)-3,7,11,15-tetramethy…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 56596738
    • 54445755
    • 12837064
    • 20246094

  • SureChEMBL

    • SCHEMBL10405071

  And 1 More

  Draw Identity 99% 90% 80% 70%

  Physical Representations

  Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	6.72	14.57	-43.55	0	2	-1	40	305.482	11	↓ MOL2 SDF SMILES Flexibase
  Lo Low (pH 4.5-6)	6.72	12.57	-5.14	1	2	0	37	306.49	11	↓ MOL2 SDF SMILES Flexibase

  More about ZINC39310150
• 39310151
  

  Analogs

  45366076

  

  2040426

  

  Popular Name: (3R,6E,10E)-3,7,11,15-tetramethylhexadeca-6,10,14-trienoic (3R,6E,10E)-3,7,11,15-tetramethy…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 12837064
    • 20246094

  • SureChEMBL

    • SCHEMBL10405071

  Draw Identity 99% 90% 80% 70%

  Physical Representations

  Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	6.72	14.57	-43.52	0	2	-1	40	305.482	11	↓ MOL2 SDF SMILES Flexibase
  Lo Low (pH 4.5-6)	6.72	12.58	-5.07	1	2	0	37	306.49	11	↓ MOL2 SDF SMILES Flexibase

  More about ZINC39310151